N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine

C15H23NO — CID 103735997

IUPACN-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine
SMILESCC1CC1c1ccc(CNCC2(C)CCC2)o1
InChIInChI=1S/C15H23NO/c1-11-8-13(11)14-5-4-12(17-14)9-16-10-15(2)6-3-7-15/h4-5,11,13,16H,3,6-10H2,1-2H3
InChIKeyWBLXSZIQFLRCFI-UHFFFAOYSA-N
MW233.35 g/mol
LogP3.68
Rot. Bonds5

About N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine

N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine (PubChem CID 103735997) has the molecular formula C15H23NO and a molecular weight of 233.35 g/mol. Its IUPAC name is N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine.

Molecular Properties

Compound NameN-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine
PubChem CID103735997
Molecular FormulaC15H23NO
Molecular Weight233.35 g/mol
Exact Mass233.18
IUPAC NameN-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine
SMILESCC1CC1c1ccc(CNCC2(C)CCC2)o1
InChIInChI=1S/C15H23NO/c1-11-8-13(11)14-5-4-12(17-14)9-16-10-15(2)6-3-7-15/h4-5,11,13,16H,3,6-10H2,1-2H3
InChIKeyWBLXSZIQFLRCFI-UHFFFAOYSA-N
XLogP3.68
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.35
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine?
The IUPAC name of N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine (CID 103735997) is N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine.
What is the SMILES notation for N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine?
The canonical SMILES for N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine is CC1CC1c1ccc(CNCC2(C)CCC2)o1.
What is the InChIKey of N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine?
The InChIKey is WBLXSZIQFLRCFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO/c1-11-8-13(11)14-5-4-12(17-14)9-16-10-15(2)6-3-7-15/h4-5,11,13,16H,3,6-10H2,1-2H3.
What are the key properties of N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine?
N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine has a molecular weight of 233.35 g/mol, XLogP of 3.68, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylcyclobutyl)methyl]-1-[5-(2-methylcyclopropyl)furan-2-yl]methanamine is sourced from PubChem (CID 103735997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).